methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate

C8H16NO3P — CID 20714261

IUPACmethyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate
SMILESCOC(=O)CC1CN(P)CC(C)O1
InChIInChI=1S/C8H16NO3P/c1-6-4-9(13)5-7(12-6)3-8(10)11-2/h6-7H,3-5,13H2,1-2H3
InChIKeyFORJGYKHJXGQDM-UHFFFAOYSA-N
MW205.19 g/mol
LogP0.43
Rot. Bonds2

About methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate

methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate (PubChem CID 20714261) has the molecular formula C8H16NO3P and a molecular weight of 205.19 g/mol. Its IUPAC name is methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate.

Molecular Properties

Compound Namemethyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate
PubChem CID20714261
Molecular FormulaC8H16NO3P
Molecular Weight205.19 g/mol
Exact Mass205.09
IUPAC Namemethyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate
SMILESCOC(=O)CC1CN(P)CC(C)O1
InChIInChI=1S/C8H16NO3P/c1-6-4-9(13)5-7(12-6)3-8(10)11-2/h6-7H,3-5,13H2,1-2H3
InChIKeyFORJGYKHJXGQDM-UHFFFAOYSA-N
XLogP0.43
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.19
LogP ≤ 50.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

methyl 2-(2,6-dimethylmorpholin-4-yl)acetate
CID 22198251
methyl 2-[(2R,4R,5R)-4-hydroxy-5-methyloxolan-2-yl]acetate
CID 10931919
methyl 2-[(2R,4S,5R)-4-hydroxy-5-methyloxolan-2-yl]acetate
CID 11105849
ethane;methyl 2-[4-(dimethylamino)-6-methyloxan-2-yl]acetate
CID 143247703
methyl 3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]butanoate
CID 104959277
methyl 2-(2,2,6-trimethyl-1,3-dioxan-4-yl)acetate
CID 85404971
methyl 2-(4-cyclopentylmorpholin-2-yl)acetate
CID 115537752
methyl 2-(2,3,3a,4,5,6-hexahydropyrrolo[1,2-b][1,2]oxazol-2-yl)acetate
CID 11019560
methyl (2S)-2-[5-(2-methoxy-2-oxoethyl)-2-oxo-1,3-oxazolidin-3-yl]propanoate
CID 102133270
methyl 2-[4-(2-methylcyclopropanecarbonyl)morpholin-2-yl]acetate
CID 79806979
methyl 2-[4-(5-methyloxolane-3-carbonyl)morpholin-2-yl]acetate
CID 114826544
methyl 2-[4-(2-morpholin-4-ylethyl)morpholin-2-yl]acetate
CID 79822697

Frequently Asked Questions

What is the IUPAC name of methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate?
The IUPAC name of methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate (CID 20714261) is methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate.
What is the SMILES notation for methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate?
The canonical SMILES for methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate is COC(=O)CC1CN(P)CC(C)O1.
What is the InChIKey of methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate?
The InChIKey is FORJGYKHJXGQDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16NO3P/c1-6-4-9(13)5-7(12-6)3-8(10)11-2/h6-7H,3-5,13H2,1-2H3.
What are the key properties of methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate?
methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate has a molecular weight of 205.19 g/mol, XLogP of 0.43, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(6-methyl-4-phosphanylmorpholin-2-yl)acetate is sourced from PubChem (CID 20714261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).